SCHEMBL23908960

SCHEMBL23908960

COC(=O)Cc1cn(CC(=O)OC(C)(C)C)c(=O)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 5/20 0.43
BRD4 O60885 1/20 0.42
GAA P10253 1/20 0.41
POLB P06746 2/20 0.40
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 1/20 0.38
EGFR P00533 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23914749 0.89 CDC25A (0.43) L3MBTL1KDM4EBRD4POLBALDH1A1
SCHEMBL5956307 0.86 GAA (0.54) L3MBTL1KDM4EGAAPOLBALDH1A1
SCHEMBL23909115 0.80 KDM4E (0.41) L3MBTL1KDM4EBRD4GAAPOLB
SCHEMBL23909042 0.75 TSHR (0.55) L3MBTL1TSHRSMN1; SMN2ALDH1A1KMT2A
SCHEMBL18171832 0.74 KDM4E (0.48) KDM4EBRD4POLBTSHRALDH1A1
SCHEMBL15076008 0.73 KDM4E (0.63) KDM4ESMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL29651147 0.72 L3MBTL1 (0.78) L3MBTL1KDM4EPOLBTSHRALDH1A1
SCHEMBL2018732 0.72 L3MBTL1 (0.78) L3MBTL1KDM4EPOLBTSHRALDH1A1
SCHEMBL8690315 0.70 S1PR2 (0.58) KDM4EGAAPOLBALDH1A1KMT2A
SCHEMBL13576829 0.70 KDM4E (0.53) L3MBTL1KDM4EGAAPOLBTSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed
US-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GILEAD SCIENCES, INC. 2021-10-14 US disclosed
US-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GILEAD SCIENCES, INC. 2021-10-14 US disclosed
CN-110869359-A Novel compounds and pharmaceutical compositions thereof for the treatment of fibrosis 加拉帕戈斯股份有限公司 2020-03-06 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS S1PR1, S1PR3, S1PR2 L3MBTL1 2938/4885KDM4E 3835/4885BRD4 1935/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.